Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

1103586 - Overview - Compound Synopsis

Synonyms
0V3
Molecular Formula
C26H30N8O
InChI
InChI=1S/C26H30N8O/c1-28-26-31-21-13-20-22(32-25(27)34-24(20)35)19(23(21)33-26)10-12-30-15-18-8-5-16(6-9-18)4-7-17-3-2-11-29-14-17/h2-3,11,13-14,16,18,30H,5-6,8-10,12,15H2,1H3,(H2,28,31,33)(H3,27,32,34,35)/t16-,18-
Smiles
CNc1nc2c(CCNCC3CCC(C#Cc4cccnc4)CC3)c3nc(N)[nH]c(=O)c3cc2[nH]1
Cross References
UniChem34729318
canSAR1103586
PDBe (Protein Data Bank Europe)0V3
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 470.254257582.80856965No


Compounds with the same scaffold


Image of compound ID: 1103586
Murko Scaffold Family: 652 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12